2-(4-pentylphenyl)carbonyloxypropyl 4-pentylbenzoate

Systemtic Name: 2-(4-pentylphenyl)carbonyloxypropyl 4-pentylbenzoate Openeye Name: 2-(4-pentylbenzoyl)oxypropyl 4-pentylbenzoate CAS Name: 4-pentylbenzoic acid 2-[oxo-(4-pentylphenyl)methoxy]propyl ester IUPAC Name: 2-(4-pentylbenzoyl)oxypropyl 4-pentylbenzoate Traditional Name: 4-amylbenzoic acid 2-(4-amylbenzoyl)oxypropyl ester Formula: C27H36O4 MolecularWeight: 424.57234

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)OCC(C)OC(=O)C2=CC=C(C=C2)CCCCC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)OCC(C)OC(=O)C2=CC=C(C=C2)CCCCC

InChI

InChI=1S/C27H36O4/c1-4-6-8-10-22-12-16-24(17-13-22)26(28)30-20-21(3)31-27(29)25-18-14-23(15-19-25)11-9-7-5-2/h12-19,21H,4-11,20H2,1-3H3